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1892-31-5 | Propanethioic acid (9CI)
CAS No: 1892-31-5 Catalog No: AG002I2L MDL No:MFCD01861900
Product Description
Catalog Number:
AG002I2L
Chemical Name:
Propanethioic acid (9CI)
CAS Number:
1892-31-5
Molecular Formula:
C3H6OS
Molecular Weight:
90.1441
MDL Number:
MFCD01861900
IUPAC Name:
propanethioic S-acid
InChI:
InChI=1S/C3H6OS/c1-2-3(4)5/h2H2,1H3,(H,4,5)
InChI Key:
KOODSCBKXPPKHE-UHFFFAOYSA-N
SMILES:
CCC(=S)O
EC Number:
217-577-1
NSC Number:
74249
Properties
Complexity:
42.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
90.014g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
90.14g/mol
Monoisotopic Mass:
90.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Variability in the concentrations of volatile metabolites emitted by genotypically different strains of Pseudomonas aeruginosa. | Journal of applied microbiology 20120901 |
| Selective orthosteric free fatty acid receptor 2 (FFA2) agonists: identification of the structural and chemical requirements for selective activation of FFA2 versus FFA3. | The Journal of biological chemistry 20110325 |
| Channeling and conformational changes in the heterotetrameric sarcosine oxidase from Corynebacterium sp. U-96. | Journal of biochemistry 20101001 |
| Comparison of volatile sulphur compound production by cheese-ripening yeasts from methionine and methionine-cysteine mixtures. | Applied microbiology and biotechnology 20070701 |
| Fabrication of steady junctions consisting of alpha,omega-bis(thioacetate) oligo(p-phenylene vinylene)s in nanogap electrodes. | Journal of the American Chemical Society 20061025 |
| Spectral and kinetic characterization of the michaelis charge transfer complex in monomeric sarcosine oxidase. | Biochemistry 20060516 |
| Monomeric sarcosine oxidase: role of histidine 269 in catalysis. | Biochemistry 20020806 |
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